chempirical

Pomalidomide

C13H11N3O4CAS 19171-19-8273.25 g/mol

Open in Covalent MOL file
NH2ONOHNOO
AmideLactamPrimary amine

Properties

Molecular formula
C13H11N3O4
Molar mass
273.25 g/mol
Exact mass
273.0750 Da
logP
0.51Crippen estimate
Polar surface area
113.1 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
1

Identifiers

CAS number
19171-19-8
SMILES
Nc1cccc2c1C(=O)N(C1CCC(O)=NC1=O)C2=O
InChIKey
UVSMNLNDYGZFPF-UHFFFAOYSA-N
InChI
InChI=1S/C13H11N3O4/c14-7-3-1-2-6-10(7)13(20)16(12(6)19)8-4-5-9(17)15-11(8)18/h1-3,8H,4-5,14H2,(H,15,17,18)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names
  • 1H-Isoindole-1,3(2H)-dione, 4-amino-2-(2,6-dioxo-3-piperidinyl)-
  • Phthalimide, 3-amino-N-(2,6-dioxo-3-piperidyl)-
  • 4-Amino-2-(2,6-dioxo-3-piperidinyl)-1H-isoindole-1,3(2H)-dione
  • 4-Amino-2-(2,6-dioxo-3-piperidyl)isoindoline-1,3-dione
  • CC 4047
  • Actimid
  • 4-Amino-2-(2,6-dioxo-3-piperidinyl)isoindole-1,3-dione
  • 4-Amino-2-(2,6-dioxopiperidine-3-yl)isoindoline-1,3-dione
  • 2-(2,6-Dioxopiperidin-3-yl)-4-amino-isoindole-1,3-dione
  • 4-Amino-2-(2,6-dioxopiperidin-3-yl)isoindoline-1,3-dione
  • Pomalyst
  • Imnovid

Work with Pomalidomide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Thalidomide50-35-172 % similar Lenalidomide191732-72-665 % similar 3-Aminophthalimide2518-24-342 % similar 2-(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)pentanedioic acid2301-52-241 % similar N-Phthaloyl-L-glutamine3343-29-139 % similar 3-Amino-2,6-piperidinedione2353-44-837 % similar 3-Aminophthalic acid5434-20-837 % similar N-Phthaloyl-(S)-phenylalanine5123-55-735 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook